Basic information
- Standard SMILES
Cc1cc(-c2ccc3cc(-c4nc5cc(C(=O)O)ccc5n4C4CCCCC4)ccc3n2)c(O)c([N+](=O)[O-])c1- InChIKey
ZXDUQRNVHARYLQ-UHFFFAOYSA-N- Molecular formula
- C30H26N4O5
- Average molar mass
- 522.5 g/mol
Names & identifiers
- Preferred name
- 1-Cyclohexyl-2-[2-(2-hydroxy-5-methyl-3-nitro-phenyl)-6-quinolyl]benzimidazole-5-carboxylic acid
- IUPAC
- 1-cyclohexyl-2-[2-(2-hydroxy-5-methyl-3-nitrophenyl)quinolin-6-yl]benzimidazole-5-carboxylic acid
Names & synonyms
SCHEMBL4131196ZXDUQRNVHARYLQ-UHFFFAOYSA-N1-cyclohexyl-2-[2-(2-hydroxy-5-methyl-3-nitro-phenyl)-6-quinolyl]benzimidazole-5-carboxylic acid1-cyclohexyl-2-[2-(2-hydroxy-5-methyl-3-nitro-phenyl)-quinolin-6-yl]-1H-benzoimidazole-5-carboxylic Acid1H-Benzimidazole-5-carboxylic acid, 1-cyclohexyl-2-[2-(2-hydroxy-5-methyl-3-nitrophenyl)-6-quinolinyl]-
Database identifiers
- PubChem CID
- 5276038
Properties
Computed structural properties
- XLogP
- 6.7
- Topological polar surface area
- 134 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 893
Related reactions
1 records
Compound notes
Loading…